CHEMBL1672615


SMILES O=C(Nc1cnc(-c2ccncc2)c(-c2ccco2)n1)C1CCC1
InChIKey XCUISAPLRLETKW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 320.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pKi 8.52 8.52 8.52 ChEMBL
A3 AA3R Human Adenosine A pKi 5.36 5.36 5.36 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.85 6.85 6.85 ChEMBL
A1 AA1R Human Adenosine A pKi 7.77 7.77 7.77 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database